SCHEMBL12480889

SCHEMBL12480889

CC(CO)(CC(Cc1ccc(-c2ccccc2F)cc1)NC(=O)c1coc(=O)[nH]1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 19/20 0.67
▸ ACE P12821 4/20 0.52
▸ SDCBP O00560 1/20 0.39
▸ SDC2 P34741 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19788105 1.00 MME (0.67) MMEACESDCBPSDC2
SCHEMBL11969828 1.00 MME (0.67) MMEACESDCBPSDC2
SCHEMBL20681858 0.93 MME (0.57) MMEACESDCBPSDC2
SCHEMBL19788075 0.89 MME (0.54) MMEACE
SCHEMBL15472712 0.89 MME (0.54) MMEACE
SCHEMBL19788107 0.83 MME (0.68) MMEACE
SCHEMBL12482007 0.83 MME (0.68) MMEACE
SCHEMBL11969639 0.83 MME (0.68) MMEACE
SCHEMBL19688130 0.83 MME (0.51) MMEACE
SCHEMBL19788106 0.82 MME (0.45) MMESDCBPSDC2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2882716-A1 NEPRILYSIN INHIBITORS Theravance Biopharma R&D IP, LLC (US) 2015-06-17 — — EP disclosed
WO-2014025891-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2014-02-13 — — WO disclosed
EP-2675795-A1 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS Theravance, Inc. (US) 2013-12-25 — — EP disclosed
WO-2012112742-A1 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-08-23 — — WO disclosed
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